Structure of PDB 6r5s Chain A Binding Site BS01

Receptor Information
>6r5s Chain A (length=271) Species: 287 (Pseudomonas aeruginosa) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
RLRIGITLHPYYSYVSNIVGDKAEVVPLIPAGFNPHAYEPRAEDIKRIGT
LDVVVLNGVGHDDFAERMIASSEKPGIPVIEANAKVPLLAKVVNPHTFLS
ISASITQVNTIARELGKLDPANAKAYTRNARAYAKRLRALRADALARLNK
APAADFRVATIHGAYDYLLREFGLEVTAVVEPAHGIEPSPSQLKKTIDQL
KALDVKVIFSEIDFPSTYVETIQRESGVKLYSLSHISYGDYSAGKYEEEM
ARNLDTVVRAIQESGAEILYF
Ligand information
Ligand IDFE2
InChIInChI=1S/Fe/q+2
InChIKeyCWYNVVGOOAEACU-UHFFFAOYSA-N
SMILES
SoftwareSMILES
ACDLabs 10.04
OpenEye OEToolkits 1.5.0		[Fe+2]
CACTVS 3.341[Fe++]
FormulaFe
NameFE (II) ION
ChEMBL
DrugBankDB14510
ZINC
PDB chain6r5s Chain A Residue 401 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB6r5s A unique ferrous iron binding mode is associated with large conformational changes for the transport protein FpvC of Pseudomonas aeruginosa.
Resolution2.75 Å
Binding residue
(original residue number in PDB)		H77 H102 H147 H213 H235 H286
Binding residue
(residue number reindexed from 1)		H36 H61 H96 H162 H184 H235
Annotation score4
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0046872 metal ion binding
Biological Process
GO:0007155 cell adhesion
GO:0030001 metal ion transport

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Molecular Function
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Biological Process
External links
PDB RCSB:6r5s, PDBe:6r5s, PDBj:6r5s
PDBsum6r5s
PubMed31318478
UniProtQ9I174

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